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La1.6 Ni O3.5 Sr0.4 |
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Crespin M, Bassat J, Odier P, Mouron P, Choisnet J |
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Journal of Solid State Chemistry 84 (1990) 165-170 |
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Synthesis and crystallographic characterization of the mixed-valence |
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reduced nickelate La1.6 Sr0.4 (Ni(+I), Ni(+II)) O3.47 |
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_cod_database_code 1001696 |
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_database_code_amcsd 0013671 |
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3.8728 3.7242 12.767 90 90 90 Immm |
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atom x y z occ |
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La1 0 0 .3610 .8 |
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Sr1 0 0 .3610 .2 |
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Ni1 0 0 0 |
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O1 0 0 .173 |
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O2 .5 0 0 .85 |
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O3 0 .5 0 .65 |
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La Ni O3.43 Sr |
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Crespin M, Landron C, Odier P, Bassat J, Mouron P, Choisnet J |
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Journal of Solid State Chemistry 100 (1992) 281-291 |
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Evidence for nickel-(I)-rich mixed oxide with a defect K2NiF4 type |
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structure |
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_cod_database_code 1001513 |
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_database_code_amcsd 0013749 |
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3.8666 3.7281 12.644 90 90 90 Immm |
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atom x y z occ |
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La1 0 0 .3586 .5 |
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Sr1 0 0 .3586 .5 |
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Ni1 0 0 0 |
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O1 0 0 .164 |
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O2 .5 0 0 |
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O3 0 .5 0 .43 |
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|
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La Ni O3.09 Sr |
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Crespin M, Landron C, Odier P, Bassat J, Mouron P, Choisnet J |
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Journal of Solid State Chemistry 100 (1992) 281-291 |
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Evidence for nickel-(I)-rich mixed oxide with a defect K2NiF4 type |
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structure |
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_cod_database_code 1001514 |
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_database_code_amcsd 0013750 |
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3.853 3.566 12.869 90 90 90 Immm |
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atom x y z occ |
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La1 0 0 .3587 .5 |
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Sr1 0 0 .3587 .5 |
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Ni1 0 0 0 |
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O1 0 0 .159 |
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O2 .5 0 0 .89 |
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O3 0 .5 0 .20 |
|
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| Download AMC data (View Text File)
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|
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La2NiO4 |
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Choisnet J, Bassat J, Pilliere H, Odier P, Leblanc M |
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Solid State Communications 66 (1988) 1245-1249 |
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A re-investigation of the crystal structure of La2NiO4 |
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Non stoichiometry and "LaO" layers |
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_cod_database_code 1000250 |
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_database_code_amcsd 0015457 |
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3.869 3.869 12.664 90 90 90 I4/mmm |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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La1 0 0 .3717 .95 .0107 .0107 .0033 0 0 0 |
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Ni1 0 0 0 .0089 .0089 .0124 0 0 0 |
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O1 0 0 .1771 .965 .0417 .0007 .0061 0 0 0 |
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O2 .5 0 0 .0146 .0160 .0190 0 0 0 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
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Ni O4.18 Pr2 |
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Allancon C, Rodriguez-Carvajal J, Fernandez-Diaz M, Odier P, Bassat J, Loup J, Martinez J |
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Zeitschrift fur Physik B 100 (1995) 85-90 |
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Crystal structure of the high temperature phase of oxidised Pr2 Ni O4+d |
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_cod_database_code 1008772 |
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_database_code_amcsd 0016649 |
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5.4492 5.4492 12.5362 90 90 90 *P4_2/ncm |
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.25 -.25 .25 |
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atom x y z occ |
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Pr1 0 0 .3597 |
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Ni1 0 0 0 |
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O1 .25 .25 -.0154 |
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O2 .25 .75 0 |
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O3 .019 .019 .1762 .585 |
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O4 .25 .25 .251 .18 |
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O5 -.068 -.068 .176 .415 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
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|
Ni O4.2 Pr2 |
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Allancon C, Rodriguez-Carvajal J, Fernandez-Diaz M, Odier P, Bassat J, Loup J, Martinez J |
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Zeitschrift fur Physik B 100 (1995) 85-90 |
|
Crystal structure of the high temperature phase of oxidised Pr2 Ni O4+d |
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_cod_database_code 1008773 |
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_database_code_amcsd 0016650 |
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5.4492 5.4492 12.5361 90 90 90 *P4_2/ncm |
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.25 -.25 .25 |
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atom x y z occ |
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Pr1 0 0 .3600 |
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Ni1 0 0 0 |
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O1 .25 .25 -.0154 |
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O2 .25 .75 0 |
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O3 .019 .019 .1749 .585 |
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O4 .25 .75 .275 .10 |
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O5 -.064 -.064 .176 .415 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
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Ni O4.216 Pr2 |
| |
Allancon C, Rodriguez-Carvajal J, Fernandez-Diaz M, Odier P, Bassat J, Loup J, Martinez J |
| |
Zeitschrift fur Physik B 100 (1995) 85-90 |
|
Crystal structure of the high temperature phase of oxidised Pr2 Ni O4+d |
|
_cod_database_code 1008774 |
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_database_code_amcsd 0016651 |
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5.4491 5.4491 12.5359 90 90 90 *P4_2/ncm |
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.25 -.25 .25 |
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atom x y z occ |
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Pr1 .001 .001 .3599 |
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Ni1 0 0 0 |
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O1 .25 .25 -.0155 |
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O2 .25 .75 0 |
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O3 .0384 .0384 .1754 .5 |
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O4 -.0384 -.0384 .1754 .5 |
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O5 .25 .25 .273 .072 |
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O6 .25 .75 .273 .072 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ni O4.18 Pr2 |
| |
Allancon C, Rodriguez-Carvajal J, Fernandez-Diaz M, Odier P, Bassat J, Loup J, Martinez J |
| |
Zeitschrift fur Physik, B 100 (1995) 85-90 |
|
Crystal structure of the high temperature phase of oxidised Pr2 Ni O4+d |
|
_cod_database_code 1006113 |
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_database_code_amcsd 0015856 |
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5.4492 5.4492 12.5362 90 90 90 *P4_2/ncm |
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.25 -.25 .25 |
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atom x y z occ |
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Pr1 0 0 .3597 |
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Ni1 0 0 0 |
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O1 .25 .25 -.0154 |
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O2 .25 .75 0 |
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O3 .019 .019 .1762 .585 |
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O4 .25 .25 .251 .18 |
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O5 -.068 -.068 .176 .415 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Ni O4.2 Pr2 |
| |
Allancon C, Rodriguez-Carvajal J, Fernandez-Diaz M, Odier P, Bassat J, Loup J, Martinez J |
| |
Zeitschrift fur Physik, B 100 (1995) 85-90 |
|
Crystal structure of the high temperature phase of oxidised Pr2 Ni O4+d |
|
_cod_database_code 1006114 |
|
_database_code_amcsd 0015857 |
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5.4492 5.4492 12.5361 90 90 90 *P4_2/ncm |
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.25 -.25 .25 |
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atom x y z occ |
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Pr1 0 0 .3600 |
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Ni1 0 0 0 |
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O1 .25 .25 -.0154 |
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O2 .25 .75 0 |
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O3 .019 .019 .1749 .585 |
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O4 .25 .75 .275 .10 |
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O5 -.064 -.064 .176 .415 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Ni O4.216 Pr2 |
| |
Allancon C, Rodriguez-Carvajal J, Fernandez-Diaz M, Odier P, Bassat J, Loup J, Martinez J |
| |
Zeitschrift fur Physik, B 100 (1995) 85-90 |
|
Crystal structure of the high temperature phase of oxidised Pr2 Ni O4+d |
|
_cod_database_code 1006115 |
|
_database_code_amcsd 0015858 |
|
5.4491 5.4491 12.5359 90 90 90 *P4_2/ncm |
|
.25 -.25 .25 |
|
atom x y z occ |
|
Pr1 .001 .001 .3599 |
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Ni1 0 0 0 |
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O1 .25 .25 -.0155 |
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O2 .25 .75 0 |
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O3 .0384 .0384 .1754 .5 |
|
O4 -.0384 -.0384 .1754 .5 |
|
O5 .25 .25 .273 .072 |
|
O6 .25 .75 .273 .072 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
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